| SpectraBase Compound ID | F6xsR5woNfT |
|---|---|
| InChI | InChI=1S/C8H6N2O2S/c1-5-2-3-7-6(4-13-9-7)8(5)10(11)12/h2-4H,1H3 |
| InChIKey | MGSFQEVCXIKNLB-UHFFFAOYSA-N |
| Mol Weight | 194.21 g/mol |
| Molecular Formula | C8H6N2O2S |
| Exact Mass | 194.014999 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1B5Gf6xGT9x |
|---|---|
| Name | 5-Methyl-4-nitro-2,1-benzothiazole |
| CAS Registry Number | 74960-03-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6N2O2S |
| InChI | InChI=1S/C8H6N2O2S/c1-5-2-3-7-6(4-13-9-7)8(5)10(11)12/h2-4H,1H3 |
| InChIKey | MGSFQEVCXIKNLB-UHFFFAOYSA-N |
| Molecular Weight | 194.208 g/mol |
| SMILES | c12c(N(=O)=O)c(C)ccc2nsc1 |
| SPLASH | splash10-0f92-4900000000-401d4616f73467182e62 |
| Source of Spectrum | Y-17-535-0 |
| Wiley ID | 1190116 |